CS-1058265
5,5-Dimethyl-8-nitro-2,3,4,5-tetrahydro-1H-benzo[b]azepine
Manufacturer: ChemScene
CAS Number: 873056-13-4
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₂H₁₆N₂O₂
Molecular Weight
220.27
Synonyms
None
SMILES
O=N(=O)C1=CC=C2C(=C1)NCCCC2(C)C
Tpsa
55.17
Logp
3.0781
H Acceptors
3
H Donors
1
Rotatable Bonds
1
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₆N₂O₂
Molecular Weight: 220.27
Synonyms: None
SMILES: O=N(=O)C1=CC=C2C(=C1)NCCCC2(C)C
Tpsa: 55.17
Logp: 3.0781
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₆N₂O₂
Molecular Weight:
220.27
Synonyms:
None
SMILES:
O=N(=O)C1=CC=C2C(=C1)NCCCC2(C)C
Tpsa:
55.17
Logp:
3.0781
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₄N₂O₂
Molecular Weight: 218.25
Synonyms: None
SMILES: C(N1[C@H](C(N)=O)CCC1=O)C2=CC=CC=C2
Tpsa: 63.4
Logp: 0.6629
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₄N₂O₂
Molecular Weight:
218.25
Synonyms:
None
SMILES:
C(N1[C@H](C(N)=O)CCC1=O)C2=CC=CC=C2
Tpsa:
63.4
Logp:
0.6629
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₈O₆
Molecular Weight: 176.12
Synonyms: None
SMILES: C(O)(=O)C1=C[C@H](O)[C@@H](O)[C@H](O)O1
Tpsa: 107.22
Logp: -1.9747
H Acceptors: 5
H Donors: 4
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₈O₆
Molecular Weight:
176.12
Synonyms:
None
SMILES:
C(O)(=O)C1=C[C@H](O)[C@@H](O)[C@H](O)O1
Tpsa:
107.22
Logp:
-1.9747
H Acceptors:
5
H Donors:
4
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₆INO
Molecular Weight: 271.05
Synonyms: None
SMILES: IC=1C=CN=C2C=CC(O)=CC12
Tpsa: 33.12
Logp: 2.545
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₆INO
Molecular Weight:
271.05
Synonyms:
None
SMILES:
IC=1C=CN=C2C=CC(O)=CC12
Tpsa:
33.12
Logp:
2.545
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0